SpectraBase Spectrum ID |
BRMqV1Cp8bA |
Name |
Butanoic acid, 3-(1-cyanoethoxy)-, [R-(R*,R*)]- |
CAS Registry Number |
99902-32-6 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C7H11NO3 |
InChI |
InChI=1S/C7H11NO3/c1-5(3-7(9)10)11-6(2)4-8/h5-6H,3H2,1-2H3,(H,9,10)/t5-,6-/m1/s1 |
InChIKey |
VGJALRWUIXQDMC-PHDIDXHHSA-N |
Molecular Weight |
157.169 g/mol |
SMILES |
OC(C[C@](O[C@@](C#N)(C)[H])(C)[H])=O |
SPLASH |
splash10-0f6w-9000000000-608385d1c5028d511dc5 |
Source of Spectrum |
H-70-462-27 |
Synonyms |
(3R)-3-{[(1R)-1-cyanoethyl]oxy}butanoic acid
(3R,5R)-5-cyano-3-methyl-4-oxahexanesaure |
Wiley ID |
1154579 |